You could use the Markus Sitzmann's Chemical Identifier Resolver,
which uses Cactvs on the backend. It provides InChI lookup and image
generation via a simple REST api.
e.g. http://cactus.nci.nih.gov/chemical/structure/InChI%3D1S/C2H3ClO/c1-2%283%294/h1H3/image
returns a GIF for InChI=1S/C2H3ClO/c1-2(3)4/h1H3
There are lots of option to control the image size, etc.
- Noel
On 6 July 2012 17:52, Peter Murray-Rust <pm286@...> wrote:
> Mat Todd has raised the exciting idea of a Craigslist for molecules - "I
> would like some of *this*". His post is at
> http://intermolecular.wordpress.com/2012/04/20/molecular-craigslist/
>
> We'll be discussing this at the OKFN hackathon tomorrow. Any ideas would be
> very welcome. Since many would be new molecules (and presumably organic) we
> can use InChI but we need a nice Open interface. We'll be looking at some of
> the latest OKF tools and maybe they will create most of what is necessary.
>
> Do we have a JS-enabled molecular viewer for InChIs, for example to embed in
> web pages?
>
> --
> Peter Murray-Rust
> Reader in Molecular Informatics
> Unilever Centre, Dep. Of Chemistry
> University of Cambridge
> CB2 1EW, UK
> +44-1223-763069
>
> ------------------------------------------------------------------------------
> Live Security Virtual Conference
> Exclusive live event will cover all the ways today's security and
> threat landscape has changed and how IT managers can respond. Discussions
> will include endpoint security, mobile security and the latest in malware
> threats. http://www.accelacomm.com/jaw/sfrnl04242012/114/50122263/
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Hello Peter,
> Do we have a JS-enabled molecular viewer for InChIs, for example to embed in web pages?
Interesting idea. To my knowledge, no. Noel offers a good start, though:
http://http://bit.ly/LVCsGK
Best,
Rich
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________________________________
From: Peter Murray-Rust <pm286@...>
To: BlueObelisk-Discuss <blueobelisk-discuss@...>
Sent: Friday, July 6, 2012 9:52 AM
Subject: [BlueObelisk-discuss] Molecular Craigslist
Mat Todd has raised the exciting idea of a Craigslist for molecules - "I would like some of *this*". His post is at http://intermolecular.wordpress.com/2012/04/20/molecular-craigslist/
We'll be discussing this at the OKFN hackathon tomorrow. Any ideas would be very welcome. Since many would be new molecules (and presumably organic) we can use InChI but we need a nice Open interface. We'll be looking at some of the latest OKF tools and maybe they will create most of what is necessary.
Do we have a JS-enabled molecular viewer for InChIs, for example to embed in web pages?
--
Peter Murray-Rust
Reader in Molecular Informatics
Unilever Centre, Dep. Of Chemistry
University of Cambridge
CB2 1EW, UK
+44-1223-763069
------------------------------------------------------------------------------
Live Security Virtual Conference
Exclusive live event will cover all the ways today's security and
threat landscape has changed and how IT managers can respond. Discussions
will include endpoint security, mobile security and the latest in malware
threats. http://www.accelacomm.com/jaw/sfrnl04242012/114/50122263/
_______________________________________________
Blueobelisk-discuss mailing list
Blueobelisk-discuss@...
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Are you aware of Innocentive (www.innocentive.com) ? They have been
operating for many years. OK, they are commercial, but backed by many
chemistry/life science companies...
On Fri, Jul 6, 2012 at 6:52 PM, Peter Murray-Rust <pm286@...> wrote:
> Mat Todd has raised the exciting idea of a Craigslist for molecules - "I
> would like some of *this*". His post is at
> http://intermolecular.wordpress.com/2012/04/20/molecular-craigslist/
>
> We'll be discussing this at the OKFN hackathon tomorrow. Any ideas would
> be very welcome. Since many would be new molecules (and presumably organic)
> we can use InChI but we need a nice Open interface. We'll be looking at
> some of the latest OKF tools and maybe they will create most of what is
> necessary.
>
> Do we have a JS-enabled molecular viewer for InChIs, for example to embed
> in web pages?
>
> --
> Peter Murray-Rust
> Reader in Molecular Informatics
> Unilever Centre, Dep. Of Chemistry
> University of Cambridge
> CB2 1EW, UK
> +44-1223-763069
>
>
> ------------------------------------------------------------------------------
> Live Security Virtual Conference
> Exclusive live event will cover all the ways today's security and
> threat landscape has changed and how IT managers can respond. Discussions
> will include endpoint security, mobile security and the latest in malware
> threats. http://www.accelacomm.com/jaw/sfrnl04242012/114/50122263/
> _______________________________________________
> Blueobelisk-discuss mailing list
> Blueobelisk-discuss@...
> https://lists.sourceforge.net/lists/listinfo/blueobelisk-discuss
>
>
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Mat Todd has raised the exciting idea of a Craigslist for molecules - "I
would like some of *this*". His post is at
http://intermolecular.wordpress.com/2012/04/20/molecular-craigslist/
We'll be discussing this at the OKFN hackathon tomorrow. Any ideas would be
very welcome. Since many would be new molecules (and presumably organic) we
can use InChI but we need a nice Open interface. We'll be looking at some
of the latest OKF tools and maybe they will create most of what is
necessary.
Do we have a JS-enabled molecular viewer for InChIs, for example to embed
in web pages?
--
Peter Murray-Rust
Reader in Molecular Informatics
Unilever Centre, Dep. Of Chemistry
University of Cambridge
CB2 1EW, UK
+44-1223-763069